N-(3-methylphenyl)-2-[3-(3-methylphenyl)-4-oxidanylidene-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-methylphenyl)-2-[3-(3-methylphenyl)-4-oxidanylidene-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl]sulfanyl-ethanamide Openeye Name: N-(m-tolyl)-2-[3-(m-tolyl)-4-oxo-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl]sulfanyl-acetamide CAS Name: N-(3-methylphenyl)-2-[[3-(3-methylphenyl)-4-oxo-2-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]yl]thio]acetamide IUPAC Name: N-(3-methylphenyl)-2-[3-(3-methylphenyl)-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl]sulfanylacetamide Traditional Name: 2-[[4-keto-3-(m-tolyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl]thio]-N-(m-tolyl)acetamide Formula: C32H31N3O2S MolecularWeight: 521.67244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC=CC(=C4)C)C5(CCCC5)CC6=CC=CC=C63

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC=CC(=C4)C)C5(CCCC5)CC6=CC=CC=C63

InChI

InChI=1S/C32H31N3O2S/c1-21-9-7-12-24(17-21)33-27(36)20-38-31-34-29-26-14-4-3-11-23(26)19-32(15-5-6-16-32)28(29)30(37)35(31)25-13-8-10-22(2)18-25/h3-4,7-14,17-18H,5-6,15-16,19-20H2,1-2H3,(H,33,36)